Photoemission from gaseous and condensed molecular carborane cluster molecules

Dongjin Byun; Sunwoo Lee; Seong Don Hwang; Yong Feng Hu; G. M. Bancroft; J. A. Glass; Jiandi Zhang; J. T. Spencer; Jian Ma; P. A. Dowben

doi:10.1016/0368-2048(94)02211-H

Photoemission from gaseous and condensed molecular carborane cluster molecules

Dongjin Byun, Sunwoo Lee, Seong Don Hwang, Yong Feng Hu, G. M. Bancroft, J. A. Glass, Jiandi Zhang, J. T. Spencer, Jian Ma, P. A. Dowben

Department of Chemistry

Research output: Contribution to journal › Article › peer-review

11 Scopus citations

Abstract

The electronic structure of the nido-2,3-R₂-2,3-dicarbahexaborane (R₂C₂B₄H₆ where R is C₂H₅) and closo-1,2-dicarbadodecaborane (C₂B₁₀H₁₂) have been studied by photoemission spectroscopy (PES). Photoemission spectra for condensed nido-2,3-diethyl-2,3-dicarbahexaborane(8) ((C₂H₅)₂C₂B₄H₆) exhibited features in good agreement with molecular orbitals assigned by modified neglect of differential overlap (MNDO) semiempirical theoretical calculations. Similar agreement can be demonstrated for the closo-1,2-dicarbadodecaborane.

Original language	English (US)
Pages (from-to)	111-116
Number of pages	6
Journal	Journal of Electron Spectroscopy and Related Phenomena
Volume	69
Issue number	2
DOIs	https://doi.org/10.1016/0368-2048(94)02211-H
State	Published - Sep 29 1994

Keywords

Carborane
Cluster
Condensed phase
Gas
MNDO
PES

ASJC Scopus subject areas

Electronic, Optical and Magnetic Materials
Radiation
Atomic and Molecular Physics, and Optics
Condensed Matter Physics
Spectroscopy
Physical and Theoretical Chemistry

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10.1016/0368-2048(94)02211-H

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@article{10e4cb00770346b78e70382e810c7f64,

title = "Photoemission from gaseous and condensed molecular carborane cluster molecules",

abstract = "The electronic structure of the nido-2,3-R2-2,3-dicarbahexaborane (R2C2B4H6 where R is C2H5) and closo-1,2-dicarbadodecaborane (C2B10H12) have been studied by photoemission spectroscopy (PES). Photoemission spectra for condensed nido-2,3-diethyl-2,3-dicarbahexaborane(8) ((C2H5)2C2B4H6) exhibited features in good agreement with molecular orbitals assigned by modified neglect of differential overlap (MNDO) semiempirical theoretical calculations. Similar agreement can be demonstrated for the closo-1,2-dicarbadodecaborane.",

keywords = "Carborane, Cluster, Condensed phase, Gas, MNDO, PES",

author = "Dongjin Byun and Sunwoo Lee and Hwang, {Seong Don} and Hu, {Yong Feng} and Bancroft, {G. M.} and Glass, {J. A.} and Jiandi Zhang and Spencer, {J. T.} and Jian Ma and Dowben, {P. A.}",

year = "1994",

month = sep,

day = "29",

doi = "10.1016/0368-2048(94)02211-H",

language = "English (US)",

volume = "69",

pages = "111--116",

journal = "Journal of Electron Spectroscopy and Related Phenomena",

issn = "0368-2048",

publisher = "Elsevier",

number = "2",

}

TY - JOUR

T1 - Photoemission from gaseous and condensed molecular carborane cluster molecules

AU - Byun, Dongjin

AU - Lee, Sunwoo

AU - Hwang, Seong Don

AU - Hu, Yong Feng

AU - Bancroft, G. M.

AU - Glass, J. A.

AU - Zhang, Jiandi

AU - Spencer, J. T.

AU - Ma, Jian

AU - Dowben, P. A.

PY - 1994/9/29

Y1 - 1994/9/29

N2 - The electronic structure of the nido-2,3-R2-2,3-dicarbahexaborane (R2C2B4H6 where R is C2H5) and closo-1,2-dicarbadodecaborane (C2B10H12) have been studied by photoemission spectroscopy (PES). Photoemission spectra for condensed nido-2,3-diethyl-2,3-dicarbahexaborane(8) ((C2H5)2C2B4H6) exhibited features in good agreement with molecular orbitals assigned by modified neglect of differential overlap (MNDO) semiempirical theoretical calculations. Similar agreement can be demonstrated for the closo-1,2-dicarbadodecaborane.

AB - The electronic structure of the nido-2,3-R2-2,3-dicarbahexaborane (R2C2B4H6 where R is C2H5) and closo-1,2-dicarbadodecaborane (C2B10H12) have been studied by photoemission spectroscopy (PES). Photoemission spectra for condensed nido-2,3-diethyl-2,3-dicarbahexaborane(8) ((C2H5)2C2B4H6) exhibited features in good agreement with molecular orbitals assigned by modified neglect of differential overlap (MNDO) semiempirical theoretical calculations. Similar agreement can be demonstrated for the closo-1,2-dicarbadodecaborane.

KW - Carborane

KW - Cluster

KW - Condensed phase

KW - Gas

KW - MNDO

KW - PES

UR - http://www.scopus.com/inward/record.url?scp=0028510547&partnerID=8YFLogxK

UR - http://www.scopus.com/inward/citedby.url?scp=0028510547&partnerID=8YFLogxK

U2 - 10.1016/0368-2048(94)02211-H

DO - 10.1016/0368-2048(94)02211-H

M3 - Article

AN - SCOPUS:0028510547

SN - 0368-2048

VL - 69

SP - 111

EP - 116

JO - Journal of Electron Spectroscopy and Related Phenomena

JF - Journal of Electron Spectroscopy and Related Phenomena

IS - 2

ER -

Photoemission from gaseous and condensed molecular carborane cluster molecules

Abstract

Keywords

ASJC Scopus subject areas

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